(3-nitrophenyl)methyl 3-(2,3-dicyanophenoxy)benzoate

Systemtic Name: (3-nitrophenyl)methyl 3-(2,3-dicyanophenoxy)benzoate Openeye Name: (3-nitrophenyl)methyl 3-(2,3-dicyanophenoxy)benzoate CAS Name: 3-(2,3-dicyanophenoxy)benzoic acid (3-nitrophenyl)methyl ester IUPAC Name: (3-nitrophenyl)methyl 3-(2,3-dicyanophenoxy)benzoate Traditional Name: 3-(2,3-dicyanophenoxy)benzoic acid (3-nitrobenzyl) ester Formula: C22H13N3O5 MolecularWeight: 399.35572

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])COC(=O)C2=CC(=CC=C2)OC3=CC=CC(=C3C#N)C#N

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])COC(=O)C2=CC(=CC=C2)OC3=CC=CC(=C3C#N)C#N

InChI

InChI=1S/C22H13N3O5/c23-12-17-6-3-9-21(20(17)13-24)30-19-8-2-5-16(11-19)22(26)29-14-15-4-1-7-18(10-15)25(27)28/h1-11H,14H2